methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate
TL;DR: methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate (CAS 727-34-4) is a chemical compound with molecular formula C10H13N3O3S2 and molecular weight 287.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate
Also Known As: methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate, N-[4-[(AMINO-METHYLSULFANYL-METHYLIDENE)AMINO]SULFONYLPHENYL]ACETAMIDE
| Molecular Formula | C10H13N3O3S2 |
|---|---|
| Molecular Weight | 287.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.03983 |
| Heavy Atoms | 18 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 727-34-4 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N=C(N)SC |
| InChIKey | HSEJCIABIJLRQU-UHFFFAOYSA-N |
Product Overview
methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate (CAS 727-34-4), with molecular formula C10H13N3O3S2 and molecular weight 287.04 g/mol. IUPAC: methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate.
Chemical Property Profile of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate
Property Insights of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate. Following Lipinski's Rule of Five, methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate?
The CAS number of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate is 727-34-4.
What is the molecular formula of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate?
The molecular formula of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate is C10H13N3O3S2.
What is the molecular weight of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate?
The molecular weight of methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate is 287.04 g/mol.
Where can I buy methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate?
You can request a quote for methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N'-(4-acetamidophenyl)sulfonylcarbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.